3-(4-Methylpiperazin-1-yl)-1-phenylpropyl phenylacetate
Basic information
- CAS
149848-04-4- Standard SMILES
CN1CCN(CCC(OC(=O)Cc2ccccc2)c2ccccc2)CC1- InChIKey
KCZPEZUEHNQJEL-UHFFFAOYSA-N- Molecular formula
- C22H28N2O2
- Average molar mass
- 352.5 g/mol
- Monoisotopic mass
- 352.21507814
Names & identifiers
- Preferred name
- 3-(4-Methylpiperazin-1-yl)-1-phenylpropyl phenylacetate
- IUPAC
- [3-(4-methylpiperazin-1-yl)-1-phenylpropyl] 2-phenylacetate
- English name
- [3-(4-methylpiperazin-1-yl)-1-phenyl-propyl] 2-phenylacetate
- Molecular formula
- C22H28N2O2
- Molecular weight
- 352.47
Names & synonyms
149848-04-4DTXSID509337733-(4-Methylpiperazin-1-yl)-1-phenylpropyl phenylacetateRefChem:1066906DTXCID8013624293-(4-Methyl-1-piperazinyl)-1-phenylpropyl benzeneacetateBenzeneacetic acid, 3-(4-methyl-1-piperazinyl)-1-phenylpropyl ester[3-(4-methylpiperazin-1-yl)-1-phenylpropyl] 2-phenylacetate[3-(4-methylpiperazin-1-yl)-1-phenyl-propyl] 2-phenylacetate
Database identifiers
- CAS
149848-04-4- PubChem CID
- 3073535
- DTXSID
DTXSID50933773- Nikkaji
- J534.844G
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 32.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 408
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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